N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide

C10H17N3O3S2 — CID 131942873

IUPACN-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide
SMILESCCc1csc(CNS(=O)(=O)N2CCOCC2)n1
InChIInChI=1S/C10H17N3O3S2/c1-2-9-8-17-10(12-9)7-11-18(14,15)13-3-5-16-6-4-13/h8,11H,2-7H2,1H3
InChIKeyGLKZVSHRXRRJPM-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.37
Rot. Bonds5

About N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide

N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide (PubChem CID 131942873) has the molecular formula C10H17N3O3S2 and a molecular weight of 291.40 g/mol. Its IUPAC name is N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide
PubChem CID131942873
Molecular FormulaC10H17N3O3S2
Molecular Weight291.40 g/mol
Exact Mass291.07
IUPAC NameN-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide
SMILESCCc1csc(CNS(=O)(=O)N2CCOCC2)n1
InChIInChI=1S/C10H17N3O3S2/c1-2-9-8-17-10(12-9)7-11-18(14,15)13-3-5-16-6-4-13/h8,11H,2-7H2,1H3
InChIKeyGLKZVSHRXRRJPM-UHFFFAOYSA-N
XLogP0.37
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide?
The IUPAC name of N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide (CID 131942873) is N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide.
What is the SMILES notation for N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide?
The canonical SMILES for N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide is CCc1csc(CNS(=O)(=O)N2CCOCC2)n1.
What is the InChIKey of N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide?
The InChIKey is GLKZVSHRXRRJPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S2/c1-2-9-8-17-10(12-9)7-11-18(14,15)13-3-5-16-6-4-13/h8,11H,2-7H2,1H3.
What are the key properties of N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide?
N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide has a molecular weight of 291.40 g/mol, XLogP of 0.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethyl-1,3-thiazol-2-yl)methyl]morpholine-4-sulfonamide is sourced from PubChem (CID 131942873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).